ethyl 10-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0456 |
| Compound Name: | ethyl 10-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C25 H21 F N2 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)N(CC(NCc1ccc(cc1)F)=O)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8412 |
| logD: | 4.8412 |
| logSw: | -4.4743 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.626 |
| InChI Key: | QTHOYLKNLMSLJO-UHFFFAOYSA-N |